methyl 2-[6-benzamido-5-oxidanyl-3-(propanoylamino)pyridin-2-yl]sulfanyl-5-(dimethylcarbamoyl)benzoate

Systemtic Name: methyl 2-[6-benzamido-5-oxidanyl-3-(propanoylamino)pyridin-2-yl]sulfanyl-5-(dimethylcarbamoyl)benzoate Openeye Name: methyl 2-[[6-benzamido-5-hydroxy-3-(propanoylamino)-2-pyridyl]sulfanyl]-5-(dimethylcarbamoyl)benzoate CAS Name: 2-[[6-benzamido-5-hydroxy-3-(1-oxopropylamino)-2-pyridinyl]thio]-5-[dimethylamino(oxo)methyl]benzoic acid methyl ester IUPAC Name: methyl 2-[6-benzamido-5-hydroxy-3-(propanoylamino)pyridin-2-yl]sulfanyl-5-(dimethylcarbamoyl)benzoate Traditional Name: 2-[(6-benzamido-5-hydroxy-3-propionamido-2-pyridyl)thio]-5-(dimethylcarbamoyl)benzoic acid methyl ester Formula: C26H26N4O6S MolecularWeight: 522.57284

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC(=C(N=C1SC2=C(C=C(C=C2)C(=O)N(C)C)C(=O)OC)NC(=O)C3=CC=CC=C3)O

Isomeric SMILES

CCC(=O)NC1=CC(=C(N=C1SC2=C(C=C(C=C2)C(=O)N(C)C)C(=O)OC)NC(=O)C3=CC=CC=C3)O

InChI

InChI=1S/C26H26N4O6S/c1-5-21(32)27-18-14-19(31)22(28-23(33)15-9-7-6-8-10-15)29-24(18)37-20-12-11-16(25(34)30(2)3)13-17(20)26(35)36-4/h6-14,31H,5H2,1-4H3,(H,27,32)(H,28,29,33)